SCHEMBL2961585

SCHEMBL2961585

CCCc1ccc(OC)c(-c2csc(NC(=O)NN3CCN(CCc4ccncc4)CC3)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 7/20 0.47
ROCK2 O75116 4/20 0.47
KMT2A Q03164 7/20 0.45
MEN1 O00255 5/20 0.45
MAPT P10636 5/20 0.45
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MAPK1 P28482 2/20 0.42
KCNQ1 P51787 1/20 0.40
ALDH1A1 P00352 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2955233 0.89 KMT2A (0.51) ROCK1ROCK2KMT2AMEN1MAPT
SCHEMBL2961641 0.88 KMT2A (0.45) ROCK1ROCK2KMT2AMEN1MAPT
SCHEMBL2957637 0.88 KMT2A (0.45) ROCK1ROCK2KMT2AMEN1MAPT
SCHEMBL2959953 0.87 KMT2A (0.44) ROCK1ROCK2KMT2AMEN1MAPT
SCHEMBL2961537 0.86 KMT2A (0.42) ROCK1ROCK2KMT2AMEN1MAPT
SCHEMBL2961877 0.84 KMT2A (0.45) ROCK1ROCK2KMT2AMEN1MAPT
SCHEMBL2953617 0.83 KMT2A (0.40) ROCK1ROCK2KMT2AMEN1MAPT
SCHEMBL2953683 0.83 ALDH1A1 (0.50) ROCK1ROCK2KMT2AMEN1MAPT
SCHEMBL2950908 0.83 KMT2A (0.45) ROCK1ROCK2KMT2AMEN1MAPT
SCHEMBL2947767 0.81 KMT2A (0.44) ROCK1ROCK2KMT2AMEN1MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1771425-B1 2-CARBAMIDE-4-PHENYLTHIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2008-05-14 EP claimed
US-20070179126-A1 2-carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2007-08-02 US claimed
US-7767681-B2 2-Carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2010-08-03 US disclosed
EP-1771425-B1 2-CARBAMIDE-4-PHENYLTHIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2008-05-14 EP disclosed
US-20070179126-A1 2-carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2007-08-02 US disclosed
EP-1771425-A1 2-CARBAMIDE-4-PHENYLTHIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2007-04-11 EP disclosed
WO-2006016039-A1 2-CARBAMIDE-4-PHENYLTHIAZOLE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2006-02-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070179126-A1 2-carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof UGT2B7, PKD2, CYP2C19 ROCK1 3931/4885ROCK2 2351/4885KMT2A 1446/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.